(3R)-1-[2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-(dibenzylamino)-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-[bis(phenylmethyl)amino]-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-(dibenzylamino)-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-(dibenzylamino)-2-keto-ethyl]piperidin-1-ium-3-carboxamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C22H27N3O2/c23-22(27)20-12-7-13-24(16-20)17-21(26)25(14-18-8-3-1-4-9-18)15-19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H2,23,27)/p+1/t20-/m1/s1